PUBCHEM-ZINC03032856
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 20 20  0  0  0  0  0  0  0  0999 V2000
   -0.0320    1.3740   -0.0480 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0250    0.1020   -0.5880 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2560   -0.5220   -0.7200 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4080    0.0810   -0.3370 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.3980    1.3490    0.1730 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1510    1.9940    0.3310 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6280    2.1350    0.5450 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6300    2.6740    1.6940 O   0  5  0  0  0  0  0  0  0  0  0  0
    3.6620   -0.7220   -0.4470 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7380   -1.7050    0.7500 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6620   -2.6040    0.4490 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.9830    1.8830    0.0760 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8830   -0.4080   -0.8940 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3400   -1.5300   -1.1160 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1220    2.9990    0.7500 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6030   -1.2380   -1.4170 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5380   -0.0750   -0.4910 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8870   -1.0690    1.6380 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7170   -2.0720    0.9370 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5290    2.2280   -0.3420 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  6  2  0  0  0  0
  1 12  1  0  0  0  0
  2  3  2  0  0  0  0
  2 13  1  0  0  0  0
  3  4  1  0  0  0  0
  3 14  1  0  0  0  0
  4  5  2  0  0  0  0
  4  9  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  6 15  1  0  0  0  0
  7  8  1  0  0  0  0
  7 20  2  0  0  0  0
  9 10  1  0  0  0  0
  9 16  1  0  0  0  0
  9 17  1  0  0  0  0
 10 11  1  0  0  0  0
 10 18  1  0  0  0  0
 10 19  1  0  0  0  0
M  CHG  1   4   1
M  CHG  1   8  -1
M  CHG  1  11  -1
M  END